(2S,3S,4R)-3-methoxy-2,4-dimethyl-5-phenylsulfanyl-pentanal

Systemtic Name: (2S,3S,4R)-3-methoxy-2,4-dimethyl-5-phenylsulfanyl-pentanal Openeye Name: (2S,3S,4R)-3-methoxy-2,4-dimethyl-5-phenylsulfanyl-pentanal CAS Name: (2S,3S,4R)-3-methoxy-2,4-dimethyl-5-(phenylthio)pentanal IUPAC Name: (2S,3S,4R)-3-methoxy-2,4-dimethyl-5-phenylsulfanylpentanal Traditional Name: (2S,3S,4R)-3-methoxy-2,4-dimethyl-5-(phenylthio)valeraldehyde Formula: C14H20O2S MolecularWeight: 252.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=CC=C1)C(C(C)C=O)OC

Isomeric SMILES

C[C@@H](CSC1=CC=CC=C1)[C@H]([C@H](C)C=O)OC

InChI

InChI=1S/C14H20O2S/c1-11(9-15)14(16-3)12(2)10-17-13-7-5-4-6-8-13/h4-9,11-12,14H,10H2,1-3H3/t11-,12+,14+/m1/s1